Recent developments in the PQS program
Author:
Affiliation:
1. Parallel Quantum Solutions, LLC, Fayetteville, AR, USA
2. Department of Chemistry, University of Arkansas, Fayetteville, AR, USA
3. Department of Chemistry, Maria Curie‐Sklodowska University, Lublin, Poland
Publisher
Wiley
Subject
Materials Chemistry,Computational Mathematics,Physical and Theoretical Chemistry,Computer Science Applications,Biochemistry
Link
https://onlinelibrary.wiley.com/doi/pdf/10.1002/wcms.80
Reference36 articles.
1. PQS version 4.0 Parallel Quantum Solutions. Fayetteville AR: LLC; Available at:http://www.pqs‐chem.com.
2. An efficient ab initio gradient program
3. Quantum chemistry in parallel with PQS
4. Array files for computational chemistry: MP2 energies
5. Parallel Calculation of Coupled Cluster Singles and Doubles Wave Functions Using Array Files
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